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  1. Third-Parties
  2. MatprojStructure
  3. mp-707875

Entry Data

Table mix-ins: ['Structure', 'Thermodynamics'] Extra columns: ['energy_uncorrected', 'band_gap', 'is_gap_direct', 'is_magnetic', 'total_magnetization', 'is_theoretical']

Base Information:

  • Database Entry ID: mp-707875
  • Created at: Sept. 4, 2022, 2:42 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 59
  • Number of elements: 5
  • Element list: ['Mn', 'Al', 'Si', 'H', 'O']
  • Chemical System: Al-H-Mn-O-Si
  • Density: 3.36258070373643
  • Atomic Density: 0.09239153156085958
  • Unit Cell Volume: 638.5866648518094
  • Molar Volume: 6.518065734231424
  • Full Formula: Mn9 Al2 Si8 H8 O32
  • Reduced Formula: Mn9Al2Si8(HO4)8
  • Formula Anonymous: A2B8C8D9E32
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1

Thermodynamics:

  • Final energy: -467.56291088
  • Final energy per atom: -7.924795099661017
  • Energy above hull: None
  • Is thermodynamically stable?: None
  • Decomposes to: None
  • Formation energy None
  • Formation energy per atom: None
Note: stabilities and hull energies are updated on a running schedule, so newer materials may have these fields blank.